In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 21 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.89 | 7.75 | -56.87 | 1 | 4 | -1 | 61 | 284.335 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.89 | 6.63 | -10.78 | 2 | 4 | 0 | 59 | 285.343 | 6 | ↓ |